SCHEMBL7897199

SCHEMBL7897199

CC(C)S(=O)(=O)NC1CCc2cc(COc3ccccc3C#N)ccc21

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 2/20 0.44
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAOB P27338 9/20 0.40
S1PR1 P21453 5/20 0.39
MAOA P21397 8/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTR6 P50406 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7899464 0.85 GRIA2 (0.46) GRIA2MAOBMAOASMN1; SMN2HTR6
SCHEMBL7896587 0.85 GRIA2 (0.46) GRIA2ATMMAOBMAOASMN1; SMN2
SCHEMBL7898384 0.83 GRIA2 (0.52) GRIA2MAOBMAOA
SCHEMBL7898805 0.77 GRIA2 (0.47) GRIA2HTR6
SCHEMBL1590737 0.75 GRIA2 (0.54) GRIA2MAOBMAOA
SCHEMBL1591092 0.75 GRIA2 (0.62) GRIA2
SCHEMBL7896403 0.74 GRIA2 (0.52) GRIA2MAOBMAOA
SCHEMBL7900252 0.72 GRIA2 (0.50) GRIA2MAOB
SCHEMBL11900094 0.72 GRIA2 (0.52) GRIA2
SCHEMBL7898009 0.72 GRIA2 (0.48) GRIA2MAOBHTR6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8633237-B2 Indane derivatives MERCK SHARP & DOHME B.V. (NL) 2014-01-21 US disclosed
US-8633237-B2 Indane derivatives MERCK SHARP & DOHME B.V. (NL) 2014-01-21 US disclosed
US-20120202781-A1 INDANE DERIVATIVES MSD OSS B.V. (NL) 2012-08-09 US disclosed
US-20120202781-A1 INDANE DERIVATIVES MSD OSS B.V. (NL) 2012-08-09 US disclosed
WO-2010115952-A1 INDANE DERIVATIVES N.V. ORGANON (NL) 2010-10-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120202781-A1 INDANE DERIVATIVES CHRNA5, CHRNA2, GRIK5 GRIA2 24/4885ATM 2085/4885L3MBTL1 4448/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.